双（2-氯乙基）胺盐酸盐 (HCID 522769)

名称与标识

首选名称: Bis(2-chloroethyl)amine hydrochloride
IUPAC: 2-chloro-N-(2-chloroethyl)ethanamine;hydrochloride
中文名: 双（2-氯乙基）胺盐酸盐
英文名: Bis(2-chloroethyl)amine hydrochloride
分子式: C4H10Cl3N
分子量: 178.49

名称与别名

Bis(2-chloroethyl)amine hydrochloride821-48-7Bis(2-chloroethyl)ammonium chloridenor-Lost hydrochloridNor-HN2 hydrochlorideDTXSID3052567di(2-chloroethyl)amine hydrochlorideDi-2-chloroethylamine hydrochlorideBi(2-chloroethyl)amine hydrochlorideNSC 10873NSC-108731,5-Dichloro-3-azapentane hydrochloride

展开更多名称

曲唑酮试剂环磷酰胺05二氯乙胺盐酸盐二氯乙醇胺盐酸盐双氯乙基胺盐酸盐环磷酰胺杂质10环磷酰胺杂质05双(2-氯乙基)胺双二氯乙基胺盐酸盐盐酸曲唑酮杂质14CyclophosphaMide Related CoMpound AAdomiparinBIS (2-CHLOROETHYL) AMINE HCLis(2-chloroethyl)aMine hydrochloride2-Chloro-N-(2-chloroethyl)ethylamine hydrochloridenc26sk555tl161leo72a

LEO-72ABis(.beta.-chloroethyl)amine hydrochlorideDTXCID4031140LY407360DGNor-lost hydrochlorid [German]Bis(beta-chloroethyl)amine hydrochlorideEthanamine, 2-chloro-N-(2-chloroethyl)-, hydrochloride (1:1)EINECS 212-479-5

数据库标识

CAS: 821-48-7
PubChem CID: 522769
DTXSID: DTXSID3052567
UNII: LY407360DG
EC Number: 212-479-5

性质

结构计算性质

极性表面积: 12 Å²
氢键供体: 2
氢键受体: 1
可旋转键: 4
重原子: 8
形式电荷: 0
复杂度: 28.9

实验与物化性质

Chemical ClassesNitrogen Compounds -> Halogenated Aliphatic Amines

Physical DescriptionOff-white powder with an irritating odor; [Alfa Aesar MSDS]

物理化学性质

熔点: 212 · 212-214 °C(lit.)
储存条件: 30 °C · Store below +30°C.
溶解度: 100 g/l · >100g/l
形态: Crystalline Powder
颜色: White to beige
水溶解性: SOLUBLE
敏感性: Hygroscopic
BRN: 3550356 · 3550356
InChI: InChI=1S/C4H9Cl2N.ClH/c5-1-3-7-4-2-6;/h7H,1-4H2;1H
InChIKey: YMDZDFSUDFLGMX-UHFFFAOYSA-N
SMILES: N(CCCl)CCCl.Cl
CAS 数据库: 821 · 821-48-7(CAS DataBase Reference)
NIST化学物质信息: 2 · 2,2'-Dichlorodiethylamine hydrochloride(821-48-7)
EPA化学物质信息: 2 · Ethanamine, 2-chloro-N-(2-chloroethyl)-, hydrochloride (821-48-7)

化学性质

白色至淡米色粉末，可溶于水但不溶于低极性和非极性的有机溶剂例如乙醚，石油醚以及正己烷等，具有较好的化学稳定性。

安全与法规

GHS分类

GHS Classification · 4 条

Danger

H290 (16.2%): May be corrosive to metals [Warning Corrosive to Metals]

P203, P234, P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P318, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P390, P403+P233, P405, P406, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 68 reports by companies from 16 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危害信息

Regulatory Information · 3 条

Chemical: Ethanamine, 2-chloro-N-(2-chloroethyl)-, hydrochloride

Status: Active Update: 07-03-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/19951

Bis(2-chloroethyl)ammonium chloride: Does not have an individual approval but may be used under an appropriate group standard

Hazards Summary · 1 条

Causes burns and lachrymation; Inhalation may cause corrosive injuries to upper respiratory tract and lungs; May cause skin sensitization; Harmful by ingestion; Toxic by inhalation; Risk of irreversible adverse health effects; Suspected mutagen; Reproductive effects observed in experimental animals; [Alfa Aesar MSDS] See 1-Chloro-2-(diethylamine)ethane hydrochloride, N,N-Dimethylaminoethyl chloride hydrochloride, and 2-Chloro-N,N-dimethyl-1-propanamine hydrochloride. Search for (821-48-7[EC/RN Number]) AND (allergic OR dermatitis OR sensitizer OR sensitization): no results; [PubMed]

Hazard Classes and CategoriesMet. Corr. 1 (16.2%)

毒理信息

Adverse EffectsDermatotoxin - Skin burns.

Toxicity DataLCLo (mouse) = 1,000 mg/m3/10min

安全数据

wgk: 3
tsca: TSCA listed
毒性: LD50 orally in Rabbit: 1150 mg/kg
RTECS号: IA1225000
hazard_note: Irritant/Toxic
包装类别: III
危险等级: 8
存储类别: 8A - Combustible corrosive hazardous materials
安全说明: 26-45-36/37/39-27
海关编码: 29211980
危险品标志: Xi,T,C
危险性类别: Acute Tox. 4 OralEye Dam. 1Met. Corr. 1Skin Corr. 1B
危险类别码: 36/37/38-36-34
危险品运输编号: 2811

毒性防护

急性毒性腹腔-大鼠 LD50: 100 毫克/公斤; 皮下-小鼠 LD50: 20 毫克/公斤

包装储运 · 3 条

可燃性危险特性可燃; 燃烧产生有毒氮氧化物, 氯化物和氯化氢烟雾

储运特性库房通风低温干燥; 与食品原料分开存放

灭火剂干粉,泡沫,沙土,二氧化碳, 雾状水

化学与工业

用途与制造

General Manufacturing InformationEthanamine, 2-chloro-N-(2-chloroethyl)-, hydrochloride (1:1): ACTIVE

应用领域

应用双（2-氯乙基）胺盐酸盐可用作有机合成与医药化学中间体，多用于有机功能材料与原料药的合成与生产。利用氮原子的亲核性，双（2-氯乙基）胺盐酸盐可用于合成酰胺类化合物。

用途用作医药中间体

制备方法

合成方法在0℃条件下，于一个干燥的反应烧瓶中将二氯亚砜（6.8克，57毫摩尔）缓慢地加入二乙醇胺（2克，19毫摩尔）在苯（10毫升）中的溶液里。然后将所得的反应混合物加热至回流，并在回流状态下搅拌反应5小时，反应结束后直接将反应混合物在减压下通过蒸馏除去反应溶剂。然后再向残留物中加入苯（10毫升），搅拌反应混合物一段时间，然后再进行一次浓缩，即可得到双（2-氯乙基）胺盐酸盐。图双（2-氯乙基）胺盐酸盐的合成路线

生产方法由二乙醇胺和氯化亚砜反应得到。将氯化亚砜溶于氯仿中，于0℃以下滴加二乙醇胺和氯仿的混合液。控制滴加速度，使温度维持在-4-6℃，加完后，保温搅拌30min。再在室温搅拌1h，加热至60-65℃，待结晶全部析出后，加无水乙醇，加热回流使全部溶解。趁热倒出，自然冷却，析出结晶。次日过滤，用氯仿或无水乙醇洗涤2次。干燥，得成品，收率76%。

试剂价格

HY-Y0881 · 25 g: 双（2-氯乙基）胺盐酸盐Bis(2-chloroethyl)amine hydrochloride — 100元
HY-Y0881 · 10 mM * 1 mL in DMSO: 双（2-氯乙基）胺盐酸盐Bis(2-chloroethyl)amine hydrochloride — 110元

供应商50 家

国药集团化学试剂有限公司86-21-63210123 · [email protected]

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

衢州润东化工有限公司0570-8789886 18892685668 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

宁波君龙新材料有限公司0574 88552216 19032109277 · [email protected]

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双（2-氯乙基）胺盐酸盐

基本信息